0 mol 1 unq 0 iso 0 dist 9.34725 6.41817 5.19589 7.42008 13.4579 9.76602 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.30501 6.41817 13.1116 7.42008 14.989 9.76602 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 7.85354 7.89222 6.76331 11.4929 14.706 9.27369 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 6.85245 9.53735 5.60332 12.1626 6.67455 8.99751 numMergedOcc 0
4 mol 26 unq 2 iso 0 dist 6.85245 9.53735 5.60332 14.2372 9.2772 9.30674 numMergedOcc 0
5 mol 26 unq 3 iso 0 dist 6.85245 9.53735 5.60332 14.8605 10.9167 8.25567 numMergedOcc 0
6 mol 26 unq 4 iso 0 dist 8.43571 9.34599 5.60332 7.53125 6.67455 8.99751 numMergedOcc 0
7 mol 26 unq 5 iso 0 dist 8.43571 9.34599 5.60332 9.31749 9.2772 9.30674 numMergedOcc 0
8 mol 26 unq 6 iso 0 dist 8.43571 9.34599 5.60332 11.7685 10.9167 8.25567 numMergedOcc 0
9 mol 26 unq 7 iso 0 dist 8.43571 6.32127 7.30207 7.53125 6.67455 9.44507 numMergedOcc 0
10 mol 54 unq 0 iso 0 dist 9.1695 5.0478 11.6507 8.88887 14.0596 4.38047 numMergedOcc 0
11 mol 112 unq 0 iso 0 dist 9.93751 6.73172 9.76776 6.50047 12.7328 5.42828 numMergedOcc 0
12 mol 116 unq 0 iso 0 dist 9.09071 7.85045 10.5909 12.6384 16.5838 7.6005 numMergedOcc 0
13 mol 116 unq 1 iso 0 dist 9.09071 7.85045 10.5909 14.5749 19.124 8.7583 numMergedOcc 0
14 mol 116 unq 2 iso 0 dist 7.7367 7.85045 6.2875 12.6384 12.4936 7.6005 numMergedOcc 0
15 mol 116 unq 3 iso 0 dist 7.7367 7.85045 6.2875 14.5749 14.7718 8.7583 numMergedOcc 0
16 mol 188 unq 0 iso 0 dist 7.82113 9.0939 10.2716 7.76882 13.5626 9.99421 numMergedOcc 0
17 mol 188 unq 1 iso 0 dist 7.82113 6.1338 5.01686 7.76882 13.5626 9.37017 numMergedOcc 0
18 mol 226 unq 0 iso 0 dist 7.64898 9.20651 4.66376 16.0868 10.7844 7.04477 numMergedOcc 0
19 mol 247 unq 0 iso 0 dist 8.0367 6.76933 11.1195 5.45251 10.9153 6.18065 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 7.7368 5.62568 5.1517 7.85119 9.38187 8.42076 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 7.7368 5.62568 5.1517 7.85119 9.38187 8.42076 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 7.7368 5.62568 5.1517 7.85119 9.38187 8.42076 numMergedOcc 0
